SCHEMBL27785763

SCHEMBL27785763

CC(=O)OC1CCN(CCOc2cc(Nc3ncc(-c4ccc(OC(F)F)cc4)cn3)ccc2F)CC1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 6/20 0.41
▸ BTK Q06187 5/20 0.41
▸ AXL P30530 1/20 0.39
▸ CSF1R P07333 1/20 0.38
▸ DYRK1A Q13627 1/20 0.37
▸ CHRM1 P11229 1/20 0.37
▸ HTR2A P28223 1/20 0.37
▸ MCHR1 Q99705 1/20 0.37
▸ CNR2 P34972 2/20 0.37
▸ EPHX2 P34913 3/20 0.37
▸ JAK3 P52333 1/20 0.36
▸ HTR1A P08908 2/20 0.36
▸ HTR7 P34969 2/20 0.36
▸ ITK Q08881 1/20 0.36
▸ DRD2 P14416 2/20 0.36
▸ IGF1R P08069 1/20 0.35
▸ HTR6 P50406 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3650361 0.88 CSF1R (0.41) EGFRBTKAXLCSF1RDYRK1A
SCHEMBL3652871 0.88 LTA4H (0.40) EGFRBTKAXLCSF1RDYRK1A
SCHEMBL13472146 0.78 CSF1R (0.42) AXLCSF1RHTR2AMCHR1EPHX2
SCHEMBL3650367 0.78 EGFR (0.39) EGFRBTKAXLDYRK1ACNR2
SCHEMBL13472149 0.78 CSF1R (0.43) BTKAXLCSF1RDYRK1AHTR2A
SCHEMBL3644492 0.77 LTA4H (0.49) EGFRAXLMCHR1JAK3DRD2
SCHEMBL3646162 0.77 EGFR (0.50) EGFRBTKHTR1AHTR7ITK
SCHEMBL27807597 0.76 EGFR (0.49) EGFRBTKITKIGF1R
SCHEMBL3650235 0.75 LTA4H (0.49) EGFRBTKHTR1AHTR7DRD2
SCHEMBL3650207 0.73 GPR6 (0.41) EGFRBTKCSF1R

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101784530-A 5- (4- (haloalkoxy) phenyl) pyrimidine-2-amine compounds and compositions as kinase inhibitors IRM LLC 2010-07-21 — — CN disclosed
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